Crystallography Open Database

Information card for entry 7235215

Preview

Coordinates	7235215.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H8 N2 O2
Calculated formula	C10 H8 N2 O2
Title of publication	Building coordination polymers using dipyridone ligands
Authors of publication	Mohan, Midhun; Maris, Thierry; Duong, Adam
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	3
Pages of publication	441 - 447
a	6.9152 ± 0.0003 Å
b	18.3958 ± 0.0008 Å
c	7.2525 ± 0.0003 Å
α	90°
β	115.199 ± 0.002°
γ	90°
Cell volume	834.8 ± 0.06 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0518
Residual factor for significantly intense reflections	0.045
Weighted residual factors for significantly intense reflections	0.1215
Weighted residual factors for all reflections included in the refinement	0.1289
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257499 (current)	2020-10-06	cif/ Updating files of 7235213, 7235214, 7235215 Original log message: Adding full bibliography for 7235213--7235215.cif.	7235215.cif
247695	2020-02-04	cif/ Updating files of 7235213, 7235214, 7235215 Original log message: Adding full bibliography for 7235213--7235215.cif.	7235215.cif
231068	2019-11-20	cif/ Adding structures of 7235213, 7235214, 7235215 via cif-deposit CGI script.	7235215.cif